[2-(3-nitrophenyl)-2-oxidanylidene-ethyl] 7-chloranyl-8-methyl-2-phenyl-quinoline-4-carboxylate

Systemtic Name: [2-(3-nitrophenyl)-2-oxidanylidene-ethyl] 7-chloranyl-8-methyl-2-phenyl-quinoline-4-carboxylate Openeye Name: [2-(3-nitrophenyl)-2-oxo-ethyl] 7-chloro-8-methyl-2-phenyl-quinoline-4-carboxylate CAS Name: 7-chloro-8-methyl-2-phenyl-4-quinolinecarboxylic acid [2-(3-nitrophenyl)-2-oxoethyl] ester IUPAC Name: [2-(3-nitrophenyl)-2-oxoethyl] 7-chloro-8-methyl-2-phenylquinoline-4-carboxylate Traditional Name: 7-chloro-8-methyl-2-phenyl-cinchoninic acid [2-keto-2-(3-nitrophenyl)ethyl] ester Formula: C25H17ClN2O5 MolecularWeight: 460.86588

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC2=C1N=C(C=C2C(=O)OCC(=O)C3=CC(=CC=C3)[N+](=O)[O-])C4=CC=CC=C4)Cl

Isomeric SMILES

CC1=C(C=CC2=C1N=C(C=C2C(=O)OCC(=O)C3=CC(=CC=C3)[N+](=O)[O-])C4=CC=CC=C4)Cl

InChI

InChI=1S/C25H17ClN2O5/c1-15-21(26)11-10-19-20(13-22(27-24(15)19)16-6-3-2-4-7-16)25(30)33-14-23(29)17-8-5-9-18(12-17)28(31)32/h2-13H,14H2,1H3